tert-butyl N-[(E)-3-chloranylprop-2-enyl]-N-(5-iodanyl-8-phenylmethoxy-quinolin-6-yl)carbamate

Systemtic Name: tert-butyl N-[(E)-3-chloranylprop-2-enyl]-N-(5-iodanyl-8-phenylmethoxy-quinolin-6-yl)carbamate Openeye Name: tert-butyl N-(8-benzyloxy-5-iodo-6-quinolyl)-N-[(E)-3-chloroallyl]carbamate CAS Name: N-[(E)-3-chloroprop-2-enyl]-N-(5-iodo-8-phenylmethoxy-6-quinolinyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E)-3-chloroprop-2-enyl]-N-(5-iodo-8-phenylmethoxyquinolin-6-yl)carbamate Traditional Name: N-(8-benzoxy-5-iodo-6-quinolyl)-N-[(E)-3-chloroallyl]carbamic acid tert-butyl ester Formula: C24H24ClIN2O3 MolecularWeight: 550.81643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC=CCl)C1=CC(=C2C(=C1I)C=CC=N2)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N(C/C=C/Cl)C1=CC(=C2C(=C1I)C=CC=N2)OCC3=CC=CC=C3

InChI

InChI=1S/C24H24ClIN2O3/c1-24(2,3)31-23(29)28(14-8-12-25)19-15-20(30-16-17-9-5-4-6-10-17)22-18(21(19)26)11-7-13-27-22/h4-13,15H,14,16H2,1-3H3/b12-8+